sodium 1-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]ethanesulfonate

Systemtic Name: sodium 1-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]ethanesulfonate Openeye Name: sodium 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]ethanesulfonate CAS Name: sodium 1-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]anilino]ethanesulfonate IUPAC Name: sodium 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]ethanesulfonate Traditional Name: sodium 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]ethanesulfonate Formula: C14H17N4NaO5S2 MolecularWeight: 408.42835

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(C)S(=O)(=O)[O-])C.[Na+]

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(C)S(=O)(=O)[O-])C.[Na+]

InChI

InChI=1S/C14H18N4O5S2.Na/c1-9-8-10(2)16-14(15-9)18-24(19,20)13-6-4-12(5-7-13)17-11(3)25(21,22)23;/h4-8,11,17H,1-3H3,(H,15,16,18)(H,21,22,23);/q;+1/p-1